1-Pentanol
TL;DR: 1-Pentanol (CAS 71-41-0) is a chemical compound with molecular formula C5H12O and molecular weight 88.08881 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
pentan-1-ol
Also Known As: 1-Pentanol, Pentan-1-ol, Amyl alcohol, Pentanol, N-Amyl alcohol
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H12O |
| Molecular Weight | 88.08881 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 88.08881 Da |
| Heavy Atoms | 6 |
| Complexity | 19.0 |
| Melting Point | -110 °F (NTP, 1992) |
| Boiling Point | 280 °F at 760 mmHg (NTP, 1992) |
| Density | 0.818 at 59 °F (USCG, 1999) - Less dense than water; will float |
| Flash Point | 91 °F (NTP, 1992) |
| Vapor Pressure | 1 mmHg at 56.5 °F ; 2.8 mmHg at 68 °F (NTP, 1992) |
| Refractive Index | Index of refraction: 1.4103 at 20 °C/D |
| Solubility | 10 to 50 mg/mL at 63 °F (NTP, 1992) |
| SMILES | CCCCCO |
| InChIKey | AMQJEAYHLZJPGS-UHFFFAOYSA-N |
Product Description
Applications: 1-Pentanol is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
1-Pentanol (CAS 71-41-0) is a pharmaceutical intermediate with the molecular formula C5H12O and a molecular weight of 88.09 g/mol. Key physical properties include a density of 0.818 at 59 °F (USCG, 1999) - Less dense than water; will float g/cm³, a solubility: 10 to 50 mg/mL at 63 °F (NTP, 1992). Synonyms include 1-Pentanol and Pentan-1-ol.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 1-Pentanol
Property Insights of 1-Pentanol
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pentanol. With a topological polar surface area (TPSA) of 20.2 Ų, 1-Pentanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pentanol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Pentanol?
The CAS number of 1-Pentanol is 71-41-0.
What is the molecular formula of 1-Pentanol?
The molecular formula of 1-Pentanol is C5H12O.
What is the molecular weight of 1-Pentanol?
The molecular weight of 1-Pentanol is 88.08881 g/mol.
What are the applications of 1-Pentanol?
1-Pentanol is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy 1-Pentanol?
You can request a quote for 1-Pentanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Pentanol?
Yes, CoreyChem provides custom synthesis services for 1-Pentanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.